chloro-bis(2-methylquinolin-8-yl)gallane

C20H16ClGaN2 — CID 174903892

IUPACchloro-bis(2-methylquinolin-8-yl)gallane
SMILESCc1ccc2cccc([Ga](Cl)c3cccc4ccc(C)nc34)c2n1
InChIInChI=1S/2C10H8N.ClH.Ga/c2*1-8-6-7-9-4-2-3-5-10(9)11-8;;/h2*2-4,6-7H,1H3;1H;/q;;;+1/p-1
InChIKeyOCLWCGYJUYCXFD-UHFFFAOYSA-M
MW389.54 g/mol
LogP3.74
Rot. Bonds2

About chloro-bis(2-methylquinolin-8-yl)gallane

chloro-bis(2-methylquinolin-8-yl)gallane (PubChem CID 174903892) has the molecular formula C20H16ClGaN2 and a molecular weight of 389.54 g/mol. Its IUPAC name is chloro-bis(2-methylquinolin-8-yl)gallane.

Molecular Properties

Compound Namechloro-bis(2-methylquinolin-8-yl)gallane
PubChem CID174903892
Molecular FormulaC20H16ClGaN2
Molecular Weight389.54 g/mol
Exact Mass388.03
IUPAC Namechloro-bis(2-methylquinolin-8-yl)gallane
SMILESCc1ccc2cccc([Ga](Cl)c3cccc4ccc(C)nc34)c2n1
InChIInChI=1S/2C10H8N.ClH.Ga/c2*1-8-6-7-9-4-2-3-5-10(9)11-8;;/h2*2-4,6-7H,1H3;1H;/q;;;+1/p-1
InChIKeyOCLWCGYJUYCXFD-UHFFFAOYSA-M
XLogP3.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.54
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 173009222
iron(3+);tris(2-methylquinolin-8-olate)
CID 139058244
tetraaluminum;hexakis(2-methylquinolin-8-ol);tris(oxygen(2-))
CID 173129908
tris[(2-methylquinolin-8-yl)oxy]gallane
CID 59002282
(2-methylquinolin-8-yl)hydrazine
CID 957615
CID 20665518
CID 20665518
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CID 143591758
8-(azetidin-3-yl)-2-methylquinoline
CID 154791422
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Frequently Asked Questions

What is the IUPAC name of chloro-bis(2-methylquinolin-8-yl)gallane?
The IUPAC name of chloro-bis(2-methylquinolin-8-yl)gallane (CID 174903892) is chloro-bis(2-methylquinolin-8-yl)gallane.
What is the SMILES notation for chloro-bis(2-methylquinolin-8-yl)gallane?
The canonical SMILES for chloro-bis(2-methylquinolin-8-yl)gallane is Cc1ccc2cccc([Ga](Cl)c3cccc4ccc(C)nc34)c2n1.
What is the InChIKey of chloro-bis(2-methylquinolin-8-yl)gallane?
The InChIKey is OCLWCGYJUYCXFD-UHFFFAOYSA-M. The full InChI is InChI=1S/2C10H8N.ClH.Ga/c2*1-8-6-7-9-4-2-3-5-10(9)11-8;;/h2*2-4,6-7H,1H3;1H;/q;;;+1/p-1.
What are the key properties of chloro-bis(2-methylquinolin-8-yl)gallane?
chloro-bis(2-methylquinolin-8-yl)gallane has a molecular weight of 389.54 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(2-methylquinolin-8-yl)gallane is sourced from PubChem (CID 174903892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).